%chk=000182677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182677

0 1
C -2.116356 -0.169125 -0.116168
C -0.610295 0.153992 0.154055
C 0.292756 -1.055755 0.562044
C 0.098915 -2.198008 -0.487956
C -2.736222 1.114072 -0.778352
C -2.197076 -1.341579 -1.127299
C -0.490844 1.337471 1.133475
C -1.387198 -2.556279 -0.669036
C 1.786387 -0.602360 0.556708
C -2.600343 2.340050 0.149089
C -1.141609 2.595996 0.545097
C -2.900736 -0.535786 1.152851
C -0.010457 -1.555188 1.985892
C 0.899941 -3.463377 -0.155512
C -4.205493 0.935573 -1.179620
C 2.300829 -0.087047 -0.791807
C 3.690205 0.581275 -0.722631
C 3.695671 1.839881 0.171578
C 4.765429 -0.406646 -0.249567
C 2.888801 2.990034 -0.425469
H -0.193139 0.505786 -0.831569
H 0.474266 -1.811031 -1.469989
H -2.153142 1.322453 -1.709939
H -1.837372 -1.007358 -2.118561
H -3.252776 -1.636154 -1.275319
H 0.575433 1.538518 1.358411
H -0.964441 1.082718 2.100105
H -1.801265 -2.958318 0.274924
H -1.487291 -3.370959 -1.410616
H 1.919825 0.190335 1.322457
H 2.418308 -1.447588 0.890005
H -3.214945 2.191988 1.057504
H -3.013922 3.234052 -0.352957
H -1.091634 3.422495 1.278217
H -0.567691 2.938813 -0.337196
H -2.866054 0.271252 1.892528
H -3.952382 -0.737215 0.928867
H -2.485304 -1.435742 1.630022
H 0.081765 -0.753418 2.724292
H -1.036811 -1.946174 2.055126
H 0.667528 -2.359166 2.286638
H 0.524775 -3.959828 0.745445
H 0.847949 -4.188271 -0.974430
H 1.958335 -3.232204 0.011896
H -4.334034 0.107377 -1.884238
H -4.841789 0.729551 -0.311763
H -4.594372 1.837776 -1.663719
H 2.339343 -0.922539 -1.517988
H 1.572668 0.641289 -1.209658
H 3.952895 0.898044 -1.764512
H 4.740044 2.169135 0.335828
H 3.298843 1.585088 1.174646
H 5.768787 0.021925 -0.339672
H 4.621827 -0.691040 0.798256
H 4.746176 -1.327166 -0.842454
H 3.263787 3.277609 -1.413782
H 2.933435 3.877866 0.214583
H 1.831173 2.720608 -0.539859


%chk=000182677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182677

0 1
C -2.252960 -0.243618 -0.114428
C -0.755498 0.207702 0.139064
C 0.270660 -0.901665 0.620887
C 0.163222 -2.135836 -0.355986
C -2.952374 0.945132 -0.893152
C -2.231035 -1.499847 -1.034453
C -0.703629 1.512978 0.977946
C -1.299348 -2.616171 -0.525005
C 1.734451 -0.315993 0.569736
C -2.895171 2.273546 -0.095171
C -1.448529 2.668450 0.270209
C -3.046411 -0.572610 1.180591
C 0.052706 -1.342122 2.097751
C 1.064120 -3.337116 0.019663
C -4.404208 0.661574 -1.348054
C 2.193382 0.360408 -0.744437
C 3.725487 0.637749 -0.838807
C 4.268944 1.525732 0.315169
C 4.546507 -0.671667 -0.946329
C 3.619272 2.924277 0.405050
H -0.394754 0.485622 -0.878526
H 0.488925 -1.776145 -1.357164
H -2.345915 1.094576 -1.816008
H -1.895397 -1.193014 -2.048832
H -3.257233 -1.901038 -1.146514
H 0.345876 1.815441 1.151285
H -1.146890 1.350675 1.979801
H -1.675237 -3.028385 0.433364
H -1.315975 -3.461309 -1.242967
H 1.848827 0.403225 1.404568
H 2.425562 -1.146522 0.808592
H -3.503655 2.178527 0.827493
H -3.366072 3.078142 -0.695215
H -1.446627 3.573645 0.909203
H -0.900443 2.931970 -0.659053
H -2.983577 0.229856 1.935750
H -4.115846 -0.724156 0.946101
H -2.688035 -1.499339 1.655991
H -0.100978 -0.466116 2.753348
H -0.812254 -2.013100 2.228094
H 0.943401 -1.878530 2.475195
H 0.771490 -3.772498 0.993085
H 0.963324 -4.134540 -0.741075
H 2.134194 -3.069094 0.073859
H -4.481734 -0.252533 -1.962486
H -5.091620 0.554992 -0.488047
H -4.776979 1.504904 -1.959742
H 1.915022 -0.272354 -1.611507
H 1.653097 1.317946 -0.879601
H 3.882173 1.203681 -1.783943
H 5.362628 1.645711 0.172874
H 4.143176 0.993595 1.279538
H 5.613876 -0.451649 -1.136740
H 4.493257 -1.262259 -0.012346
H 4.178004 -1.309696 -1.771759
H 3.721980 3.470756 -0.551954
H 4.095395 3.534848 1.194486
H 2.540525 2.860963 0.639508


